==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DIHYDROLIPOAMIDE ACETYLTRANSFERASE 29-JUN-99 1QJO . COMPND 2 MOLECULE: DIHYDROLIPOAMIDE ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.D.JONES,M.J.HOWARD,R.N.PERHAM . 80 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5138.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 51 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 33.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 14 17.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 178 0, 0.0 75,-0.6 0, 0.0 73,-0.0 0.000 360.0 360.0 360.0 78.8 18.0 2.2 6.8 2 2 A V E -A 75 0A 85 73,-0.2 2,-0.3 71,-0.0 73,-0.3 -0.038 360.0-166.7 -56.2 158.4 14.3 1.0 6.8 3 3 A K E -A 74 0A 92 71,-3.3 71,-2.3 2,-0.0 2,-0.2 -0.968 19.2-118.2-139.8 149.9 11.3 3.2 6.4 4 4 A E E -A 73 0A 118 -2,-0.3 2,-0.5 69,-0.2 69,-0.2 -0.637 16.5-140.4 -96.3 155.0 7.5 2.5 6.9 5 5 A V E -A 72 0A 0 67,-2.5 67,-0.9 -2,-0.2 2,-0.2 -0.953 22.4-176.6-116.5 117.3 4.8 2.7 4.3 6 6 A N - 0 0 64 -2,-0.5 64,-0.2 64,-0.3 63,-0.2 -0.626 34.2-104.4-108.5 169.4 1.4 4.1 5.3 7 7 A V - 0 0 0 62,-0.8 61,-2.9 59,-0.4 3,-0.2 -0.852 35.8-167.9 -94.9 115.0 -1.8 4.5 3.4 8 8 A P - 0 0 45 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.973 59.9 -14.0 -66.6 -90.7 -2.2 8.3 2.4 9 9 A D + 0 0 120 58,-0.1 3,-0.0 59,-0.0 57,-0.0 -0.963 52.4 167.0-123.8 116.5 -5.7 9.1 1.1 10 10 A I - 0 0 5 -2,-0.4 2,-2.7 -3,-0.2 36,-0.1 -0.186 55.2-111.8-123.0 43.4 -8.3 6.4 0.1 11 11 A G S S- 0 0 83 2,-0.0 2,-0.2 33,-0.0 -1,-0.1 -0.295 78.7 -2.8 62.8 -64.3 -11.4 8.7 -0.1 12 12 A G S S- 0 0 38 -2,-2.7 55,-0.3 -3,-0.0 -2,-0.1 -0.591 94.6 -26.4-136.8-163.1 -13.3 7.4 3.0 13 13 A D S S- 0 0 156 -2,-0.2 2,-0.3 1,-0.1 54,-0.3 0.727 96.5 -19.3 -9.9-106.3 -13.8 5.0 5.9 14 14 A E + 0 0 125 52,-0.1 2,-0.3 50,-0.0 52,-0.2 -0.963 58.3 179.8-125.9 140.4 -12.2 1.5 5.7 15 15 A V E -D 65 0B 9 50,-1.8 50,-2.9 -2,-0.3 2,-0.2 -0.936 13.5-143.3-139.1 162.3 -10.9 -0.5 2.7 16 16 A E E -DE 64 38B 61 22,-2.3 22,-2.3 -2,-0.3 2,-0.6 -0.756 29.6 -95.5-120.6 170.3 -9.3 -3.9 2.1 17 17 A V E + E 0 37B 2 46,-2.2 45,-1.1 43,-0.3 46,-0.3 -0.785 38.6 163.0 -97.6 120.8 -6.6 -5.1 -0.4 18 18 A T E S+ 0 0 56 18,-2.6 2,-0.4 -2,-0.6 19,-0.2 0.812 80.2 21.1 -96.5 -46.2 -7.7 -6.7 -3.7 19 19 A E E - E 0 36B 106 17,-1.7 17,-2.6 43,-0.0 2,-2.5 -0.826 60.1-167.9-131.7 98.5 -4.4 -6.5 -5.5 20 20 A V - 0 0 23 -2,-0.4 15,-0.2 15,-0.2 41,-0.1 -0.404 18.0-175.7 -81.6 68.7 -1.1 -6.1 -3.5 21 21 A M + 0 0 80 -2,-2.5 -1,-0.2 2,-0.0 14,-0.2 0.793 56.1 55.1 -32.5 -56.1 0.9 -5.2 -6.7 22 22 A V - 0 0 11 12,-1.3 2,-0.2 -3,-0.2 12,-0.0 -0.395 66.7-168.2 -87.7 164.8 4.4 -5.0 -5.1 23 23 A K > - 0 0 106 -2,-0.1 2,-1.4 31,-0.1 3,-0.9 -0.575 41.9 -46.2-131.8-166.4 6.4 -7.6 -3.1 24 24 A V T 3 S+ 0 0 95 1,-0.2 31,-0.2 -2,-0.2 32,-0.1 -0.534 127.5 9.5 -74.4 86.4 9.4 -8.3 -0.8 25 25 A G T 3 S+ 0 0 46 -2,-1.4 -1,-0.2 29,-0.2 30,-0.1 0.219 93.6 145.1 126.6 -11.5 12.4 -6.6 -2.7 26 26 A D < - 0 0 54 -3,-0.9 28,-1.8 27,-0.1 2,-0.7 0.072 53.7-110.6 -55.0 163.9 10.5 -4.7 -5.4 27 27 A K E +B 53 0A 171 26,-0.2 2,-0.3 2,-0.0 26,-0.2 -0.859 42.1 179.4-100.2 102.3 11.3 -1.3 -6.9 28 28 A V E +B 52 0A 7 24,-2.5 24,-2.8 -2,-0.7 2,-0.3 -0.819 10.1 177.1-113.8 148.8 8.7 1.4 -5.8 29 29 A A > - 0 0 45 -2,-0.3 3,-1.3 22,-0.3 19,-0.6 -0.973 40.5 -85.2-141.0 154.7 8.4 5.1 -6.6 30 30 A A B 3 S+g 48 0C 48 -2,-0.3 2,-0.5 1,-0.2 3,-0.1 -0.060 113.5 22.3 -55.0 163.8 5.9 7.8 -5.7 31 31 A E T 3 S+ 0 0 187 17,-0.5 2,-0.9 1,-0.2 -1,-0.2 0.260 96.7 112.3 60.5 -16.5 2.7 8.1 -8.0 32 32 A Q S < S- 0 0 112 -3,-1.3 16,-1.0 -2,-0.5 -3,-0.2 -0.751 82.4-108.1 -88.8 107.0 3.4 4.4 -9.0 33 33 A S E - F 0 47B 16 -2,-0.9 3,-0.1 14,-0.2 -4,-0.1 0.076 36.3-176.1 -36.6 138.4 0.5 2.5 -7.6 34 34 A L E + 0 0 0 12,-2.6 -12,-1.3 1,-0.3 2,-0.3 0.847 63.4 2.8-102.1 -59.4 1.2 0.2 -4.6 35 35 A I E - F 0 46B 1 11,-1.9 11,-1.9 -15,-0.2 2,-0.5 -0.994 61.5-132.8-140.3 130.9 -1.9 -1.7 -3.6 36 36 A T E -EF 19 45B 9 -17,-2.6 -18,-2.6 -2,-0.3 -17,-1.7 -0.729 32.5-161.8 -83.6 123.1 -5.5 -1.8 -5.2 37 37 A V E +EF 17 44B 0 7,-2.5 7,-2.8 -2,-0.5 -20,-0.2 -0.888 12.2 178.8-115.7 141.6 -8.0 -1.5 -2.3 38 38 A E E +E 16 0B 70 -22,-2.3 -22,-2.3 -2,-0.4 5,-0.1 -0.516 23.0 136.6-122.6-171.6 -11.8 -2.3 -2.2 39 39 A G S S+ 0 0 44 3,-0.4 -1,-0.1 -24,-0.2 4,-0.1 0.065 70.6 25.3 156.3 -39.1 -14.9 -2.2 0.2 40 40 A D S S- 0 0 100 2,-0.5 -1,-0.1 0, 0.0 -2,-0.0 0.482 113.4 -50.7-111.0-106.3 -18.2 -0.8 -1.2 41 41 A K S S+ 0 0 203 -3,-0.0 2,-0.2 2,-0.0 -3,-0.0 0.379 114.6 69.0-117.8 -11.6 -19.4 -0.7 -4.9 42 42 A A S S- 0 0 45 0, 0.0 -2,-0.5 0, 0.0 2,-0.5 -0.647 72.6-128.9-113.1 168.1 -16.2 0.9 -6.2 43 43 A S - 0 0 93 -2,-0.2 2,-0.3 -5,-0.1 -5,-0.2 -0.960 28.9-177.9-116.6 124.7 -12.5 -0.0 -6.8 44 44 A M E -F 37 0B 73 -7,-2.8 -7,-2.5 -2,-0.5 2,-0.3 -0.814 11.9-145.2-122.0 164.9 -9.7 2.3 -5.4 45 45 A E E -F 36 0B 101 -9,-0.3 -9,-0.2 -2,-0.3 -12,-0.0 -0.933 2.3-151.1-129.8 153.5 -5.9 2.4 -5.5 46 46 A V E -F 35 0B 0 -11,-1.9 -12,-2.6 -2,-0.3 -11,-1.9 -0.966 17.2-159.6-124.7 113.0 -3.1 3.4 -3.2 47 47 A P E -F 33 0B 43 0, 0.0 -14,-0.2 0, 0.0 -17,-0.1 -0.227 38.3 -66.0 -84.6 177.5 0.3 4.7 -4.6 48 48 A A B -g 30 0C 6 -16,-1.0 -17,-0.5 -19,-0.6 -16,-0.1 -0.496 28.4-146.8 -69.3 114.7 3.7 4.9 -3.0 49 49 A P S S- 0 0 48 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.784 84.5 -24.7 -46.8 -27.7 4.1 7.4 -0.0 50 50 A F S S- 0 0 34 -21,-0.1 2,-0.2 -20,-0.0 -45,-0.0 -0.930 82.4 -72.3-167.1-175.3 7.7 7.8 -1.4 51 51 A A + 0 0 54 -2,-0.3 2,-0.3 -22,-0.2 -22,-0.3 -0.489 68.7 63.6 -97.3 164.1 10.4 6.1 -3.5 52 52 A G E S-B 28 0A 15 -24,-2.8 -24,-2.5 24,-0.2 2,-0.3 -0.966 79.4 -42.8 128.8-144.7 13.0 3.1 -3.1 53 53 A V E -BC 27 75A 30 22,-1.9 22,-1.9 -2,-0.3 2,-0.3 -0.794 46.8-112.0-121.9 166.6 12.5 -0.6 -2.5 54 54 A V E + C 0 74A 4 -28,-1.8 20,-0.3 -2,-0.3 -29,-0.2 -0.767 30.5 170.1 -98.3 142.1 10.2 -2.9 -0.4 55 55 A K E - 0 0 92 18,-2.6 2,-0.3 1,-0.4 19,-0.2 0.762 60.0 -8.0-115.9 -63.9 11.6 -5.0 2.5 56 56 A E E - C 0 73A 89 17,-1.5 17,-3.3 -32,-0.1 -1,-0.4 -0.932 52.3-171.0-135.8 158.5 8.9 -6.6 4.7 57 57 A L - 0 0 30 -2,-0.3 2,-1.2 15,-0.2 15,-0.2 -0.827 17.5-161.1-156.0 115.8 5.0 -6.4 4.9 58 58 A K + 0 0 189 12,-0.3 2,-0.3 -2,-0.3 14,-0.1 -0.257 65.6 101.2 -90.7 52.5 2.6 -7.8 7.6 59 59 A V - 0 0 17 -2,-1.2 2,-0.2 4,-0.1 -2,-0.0 -0.981 51.4-159.1-137.2 149.1 -0.4 -7.5 5.2 60 60 A N > - 0 0 112 -2,-0.3 3,-1.5 4,-0.1 2,-1.0 -0.723 34.0 -95.4-122.7 172.0 -2.5 -9.8 2.9 61 61 A V T 3 S+ 0 0 80 1,-0.3 -43,-0.2 -2,-0.2 3,-0.1 -0.783 121.0 29.9 -95.1 111.4 -4.9 -9.6 -0.1 62 62 A G T 3 S+ 0 0 57 -45,-1.1 -1,-0.3 -2,-1.0 -44,-0.1 0.287 103.4 111.4 117.0 8.7 -8.3 -9.5 1.5 63 63 A D < - 0 0 60 -3,-1.5 -46,-2.2 -46,-0.3 2,-0.4 -0.313 68.9 -87.5 -94.8 177.5 -6.8 -7.8 4.6 64 64 A K E +D 16 0B 90 -48,-0.2 2,-0.3 -2,-0.1 -48,-0.2 -0.744 37.9 164.4-108.7 144.5 -7.4 -4.1 5.8 65 65 A V E +D 15 0B 4 -50,-2.9 -50,-1.8 -2,-0.4 2,-0.3 -0.986 4.3 161.5-142.3 150.2 -5.9 -0.7 5.2 66 66 A K > - 0 0 97 -2,-0.3 3,-2.0 -52,-0.2 -59,-0.4 -0.968 57.2 -42.8-161.7 162.5 -7.1 2.9 5.9 67 67 A T T 3 S+ 0 0 73 -55,-0.3 -58,-0.1 -2,-0.3 -61,-0.0 -0.001 128.0 6.9 -41.5 113.7 -5.4 6.4 6.2 68 68 A G T 3 S+ 0 0 39 -61,-2.9 -1,-0.2 1,-0.3 -59,-0.0 -0.145 87.0 143.8 105.0 -35.9 -2.2 6.0 8.2 69 69 A S < - 0 0 45 -3,-2.0 2,-2.3 -63,-0.2 -62,-0.8 0.014 61.1-113.0 -38.3 132.9 -2.1 2.2 8.5 70 70 A L + 0 0 110 -64,-0.2 -12,-0.3 1,-0.2 -64,-0.3 -0.285 41.2 176.8 -70.6 57.0 1.5 0.7 8.2 71 71 A I - 0 0 4 -2,-2.3 2,-0.3 -14,-0.1 -1,-0.2 0.772 58.7 -34.7 -23.1 -64.0 1.1 -1.1 4.9 72 72 A M E -A 5 0A 4 -67,-0.9 -67,-2.5 -15,-0.2 2,-0.6 -0.969 60.4 -97.3-159.2 171.9 4.7 -2.3 4.6 73 73 A I E -AC 4 56A 53 -17,-3.3 -18,-2.6 -2,-0.3 -17,-1.5 -0.900 37.2-176.6-110.8 120.5 8.4 -1.4 5.4 74 74 A F E -AC 3 54A 0 -71,-2.3 -71,-3.3 -2,-0.6 2,-0.3 -0.372 16.0-150.3 -99.1 176.0 10.5 0.1 2.6 75 75 A E E -AC 2 53A 39 -22,-1.9 2,-2.3 -73,-0.3 -22,-1.9 -0.888 30.6-115.4-156.4 115.9 14.2 1.0 2.6 76 76 A V S S- 0 0 72 -75,-0.6 -24,-0.2 -2,-0.3 2,-0.1 -0.350 75.4 -55.4 -60.3 73.6 15.3 3.9 0.3 77 77 A E - 0 0 141 -2,-2.3 -24,-0.2 1,-0.1 0, 0.0 -0.428 50.7-162.3 83.2-155.3 17.5 1.8 -2.1 78 78 A G - 0 0 63 -2,-0.1 -1,-0.1 2,-0.1 -2,-0.0 0.475 48.0 -95.9 136.1 58.3 20.5 -0.3 -0.8 79 79 A A 0 0 99 1,-0.1 -2,-0.0 0, 0.0 0, 0.0 0.372 360.0 360.0 4.3 50.9 22.7 -1.1 -3.7 80 80 A A 0 0 162 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.031 360.0 360.0 -32.4 360.0 21.3 -4.5 -4.6